2-{[(2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)imino]methyl}phenol
Chemical Structure Depiction of
2-{[(2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)imino]methyl}phenol
2-{[(2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)imino]methyl}phenol
Compound characteristics
| Compound ID: | 8009-4116 |
| Compound Name: | 2-{[(2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)imino]methyl}phenol |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C25 H17 F N2 O S2 |
| Smiles: | C(c1ccc(c2ccccc12)F)Sc1nc2ccc(cc2s1)/N=C/c1ccccc1O |
| Stereo: | ACHIRAL |
| logP: | 7.4141 |
| logD: | 7.3809 |
| logSw: | -6.079 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.452 |
| InChI Key: | JUQQJLPTVIOJRI-UHFFFAOYSA-N |